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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H19Cl2N3O
Molecular Weight 328.237
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BERSIPOROCIN

SMILES

O[C@H]1CCCN[C@@H]1CCCN2C=NC3=C2C=CC(Cl)=C3Cl

InChI

InChIKey=VXCNMWNXDDMFSX-YPMHNXCESA-N
InChI=1S/C15H19Cl2N3O/c16-10-5-6-12-15(14(10)17)19-9-20(12)8-2-3-11-13(21)4-1-7-18-11/h5-6,9,11,13,18,21H,1-4,7-8H2/t11-,13+/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H19Cl2N3O
Molecular Weight 328.237
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
TTU6QSK1G5
Record Status Validated (UNII)
Record Version